Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:19:07 UTC
Update Date2025-03-25 01:48:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02523399
Frequency0.5
Structure
Chemical FormulaC6H11N2O+
Molecular Mass127.0866
SMILESCC1=[N+](C)CCC(=O)N1
InChI KeyHMPFNIMBMADHSD-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydropyrimidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • 1,4,5,6-tetrahydropyrimidine
  • carbonyl group
  • azacycle
  • carboximidamide
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hydropyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound